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Home > Aldehydes > 1805421-14-0
1805421-14-0 | Benzaldehyde, 4-bromo-2-fluoro-6-methyl-
CAS No: 1805421-14-0 Catalog No: AG00222U MDL No:MFCD28739694
Product Description
Catalog Number:
AG00222U
Chemical Name:
Benzaldehyde, 4-bromo-2-fluoro-6-methyl-
CAS Number:
1805421-14-0
Molecular Formula:
C8H6BrFO
Molecular Weight:
217.0350
MDL Number:
MFCD28739694
IUPAC Name:
4-bromo-2-fluoro-6-methylbenzaldehyde
InChI:
InChI=1S/C8H6BrFO/c1-5-2-6(9)3-8(10)7(5)4-11/h2-4H,1H3
InChI Key:
OTQPMRUIEAOUTJ-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)cc(cc1F)Br
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.959g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.037g/mol
Monoisotopic Mass:
215.959g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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